About 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine
4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine (PubChem CID 160865022) has the molecular formula C158H145F6N27O14S8
and a molecular weight of 3016.60 g/mol. Its IUPAC name is 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine.
Frequently Asked Questions
What is the IUPAC name of 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine (CID 160865022) is 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine is COC1CCN1c1c[nH]c2nccc(-c3ccsc3)c12.COc1ccc(-c2c[nH]c3nccc(-c4ccsc4)c23)c(OC)n1.COc1ccccc1-c1c[nH]c2nccc(-c3sccc3C)c12.COc1ccccc1-c1c[nH]c2nccc(N3CC(F)(F)C3)c12.COc1ccccc1-c1c[nH]c2nccc(N3CCC3CO)c12.COc1ccccc1-c1c[nH]c2nccc(N3CCN(S(C)(=O)=O)CC3)c12.COc1ncccc1-c1c[nH]c2nccc(-c3sccc3C)c12.CS(=O)(=O)N1CCN(c2c[nH]c3nccc(-c4ccsc4)c23)CC1.Fc1cc(OC(F)(F)F)ccc1-c1c[nH]c2nccc(-c3ccsc3)c12.
What is the InChIKey of 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is SKZMWPOMUNNLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3S.C19H16N2OS.C18H10F4N2OS.C18H15N3O2S.C18H19N3O2.C18H15N3OS.C17H15F2N3O.C16H18N4O2S2.C15H15N3OS/c1-26-17-6-4-3-5-14(17)15-13-21-19-18(15)16(7-8-20-19)22-9-11-23(12-10-22)27(2,24)25;1-12-8-10-23-18(12)14-7-9-20-19-17(14)15(11-21-19)13-5-3-4-6-16(13)22-2;19-15-7-11(25-18(20,21)22)1-2-13(15)14-8-24-17-16(14)12(3-5-23-17)10-4-6-26-9-10;1-22-15-4-3-13(18(21-15)23-2)14-9-20-17-16(14)12(5-7-19-17)11-6-8-24-10-11;1-23-16-5-3-2-4-13(16)14-10-20-18-17(14)15(6-8-19-18)21-9-7-12(21)11-22;1-11-6-9-23-16(11)13-5-8-19-17-15(13)14(10-21-17)12-4-3-7-20-18(12)22-2;1-23-14-5-3-2-4-11(14)12-8-21-16-15(12)13(6-7-20-16)22-9-17(18,19)10-22;1-24(21,22)20-7-5-19(6-8-20)14-10-18-16-15(14)13(2-4-17-16)12-3-9-23-11-12;1-19-13-3-6-18(13)12-8-17-15-14(12)11(2-5-16-15)10-4-7-20-9-10/h3-8,13H,9-12H2,1-2H3,(H,20,21);3-11H,1-2H3,(H,20,21);1-9H,(H,23,24);3-10H,1-2H3,(H,19,20);2-6,8,10,12,22H,7,9,11H2,1H3,(H,19,20);3-10H,1-2H3,(H,19,21);2-8H,9-10H2,1H3,(H,20,21);2-4,9-11H,5-8H2,1H3,(H,17,18);2,4-5,7-9,13H,3,6H2,1H3,(H,16,17).
What are the key properties of 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine?
4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 3016.60 g/mol, XLogP of 34.98, 30 rotatable bonds, 10 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,3-difluoroazetidin-1-yl)-3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2,6-dimethoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[2-fluoro-4-(trifluoromethoxy)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyazetidin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(4-methylsulfonylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;[1-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]azetidin-2-yl]methanol;3-(2-methoxy-3-pyridinyl)-4-(3-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-methylsulfonylpiperazin-1-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 160865022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).